Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 8/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.36 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 6/20 | 0.34 |
| ▸ | HTR2B | P41595 | 3/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | F12 | P00748 | 2/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | CD44 | P16070 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL14047930 | 0.93 | HTR2A (0.42) | SIGMAR1HTR2CHTR2BHTR2A | |
| SCHEMBL13329622 | 0.90 | HTR2C (0.37) | SIGMAR1PARP1TNKS2HTR2CHTR2B | |
| SCHEMBL14047939 | 0.88 | SIGMAR1 (0.41) | SIGMAR1PARP1TNKS2PARP2HTR2C | |
| SCHEMBL13249768 | 0.85 | SIGMAR1 (0.41) | SIGMAR1PARP1TNKS2PARP2HTR2C | |
| SCHEMBL14047692 | 0.83 | SIGMAR1 (0.35) | SIGMAR1PARP1TNKS2PARP2HTR2C | |
| SCHEMBL13250502 | 0.82 | SIGMAR1 (0.39) | SIGMAR1PARP1TNKS2PARP2HTR2C | |
| SCHEMBL13250510 | 0.82 | SIGMAR1 (0.39) | SIGMAR1PARP1TNKS2PARP2HTR2C | |
| SCHEMBL13250516 | 0.79 | SIGMAR1 (0.36) | SIGMAR1PARP1TNKS2PARP2HTR2C | |
| SCHEMBL14047934 | 0.77 | HTR2A (0.31) | HTR2AMEN1KMT2A | |
| SCHEMBL13250488 | 0.77 | HTR2A (0.32) | HTR2AMEN1KMT2A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008130581-A1 | PYRIMIDINONE DERIVATIVES AND METHODS OF USE THEREOF | SCHERING CORPORATION (US) | 2008-10-30 | — | — | WO | disclosed |